methyl 2-[[(4R)-3,3-dimethyl-4-(2-oxidanylideneethyl)cyclopenten-1-yl]methylsulfanyl]ethanoate

Systemtic Name: methyl 2-[[(4R)-3,3-dimethyl-4-(2-oxidanylideneethyl)cyclopenten-1-yl]methylsulfanyl]ethanoate Openeye Name: methyl 2-[[(4R)-3,3-dimethyl-4-(2-oxoethyl)cyclopenten-1-yl]methylsulfanyl]acetate CAS Name: 2-[[(4R)-3,3-dimethyl-4-(2-oxoethyl)-1-cyclopentenyl]methylthio]acetic acid methyl ester IUPAC Name: methyl 2-[[(4R)-3,3-dimethyl-4-(2-oxoethyl)cyclopenten-1-yl]methylsulfanyl]acetate Traditional Name: 2-[[(4R)-4-(2-ketoethyl)-3,3-dimethyl-cyclopenten-1-yl]methylthio]acetic acid methyl ester Formula: C13H20O3S MolecularWeight: 256.3611

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(CC1CC=O)CSCC(=O)OC)C

Isomeric SMILES

CC1(C=C(C[C@@H]1CC=O)CSCC(=O)OC)C

InChI

InChI=1S/C13H20O3S/c1-13(2)7-10(6-11(13)4-5-14)8-17-9-12(15)16-3/h5,7,11H,4,6,8-9H2,1-3H3/t11-/m0/s1